2-(1-Piperidinylmethyl)-1H-isoindole-1,3(2H)-dione
TL;DR: 2-(1-Piperidinylmethyl)-1H-isoindole-1,3(2H)-dione (CAS 4667-76-9) is a chemical compound with molecular formula C14H16N2O2 and molecular weight 244.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(piperidin-1-ylmethyl)isoindole-1,3-dione
Also Known As: 2-(Piperidino)methylphthalimide, ChemDiv3_000920, N-Piperidinomethyl-phthalimid, Phthalimide, N-(piperidino)methyl-, N-(1-Piperidinylmethyl)phthalimide
| Molecular Formula | C14H16N2O2 |
|---|---|
| Molecular Weight | 244.12 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 40.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 244.12119 |
| Heavy Atoms | 18 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 4667-76-9 |
|---|---|
| SMILES | C1CCN(CC1)CN2C(=O)C3=CC=CC=C3C2=O |
| InChIKey | ORXFTDOQEHBVCY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(1-Piperidinylmethyl)-1H-isoindole-1,3(2H)-dione (CAS 4667-76-9), with molecular formula C14H16N2O2 and molecular weight 244.12 g/mol. IUPAC: 2-(piperidin-1-ylmethyl)isoindole-1,3-dione.
Chemical Property Profile of 2-(1-Piperidinylmethyl)-1H-isoindole-1,3(2H)-dione
Property Insights of 2-(1-Piperidinylmethyl)-1H-isoindole-1,3(2H)-dione
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1-Piperidinylmethyl)-1H-isoindole-1,3(2H)-dione. With a topological polar surface area (TPSA) of 40.6 Ų, 2-(1-Piperidinylmethyl)-1H-isoindole-1,3(2H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1-Piperidinylmethyl)-1H-isoindole-1,3(2H)-dione has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(1-Piperidinylmethyl)-1H-isoindole-1,3(2H)-dione?
The CAS number of 2-(1-Piperidinylmethyl)-1H-isoindole-1,3(2H)-dione is 4667-76-9.
What is the molecular formula of 2-(1-Piperidinylmethyl)-1H-isoindole-1,3(2H)-dione?
The molecular formula of 2-(1-Piperidinylmethyl)-1H-isoindole-1,3(2H)-dione is C14H16N2O2.
What is the molecular weight of 2-(1-Piperidinylmethyl)-1H-isoindole-1,3(2H)-dione?
The molecular weight of 2-(1-Piperidinylmethyl)-1H-isoindole-1,3(2H)-dione is 244.12 g/mol.
Where can I buy 2-(1-Piperidinylmethyl)-1H-isoindole-1,3(2H)-dione?
You can request a quote for 2-(1-Piperidinylmethyl)-1H-isoindole-1,3(2H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-Piperidinylmethyl)-1H-isoindole-1,3(2H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-Piperidinylmethyl)-1H-isoindole-1,3(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.